| CAS Number | 159976-73-5 |
| Catalog Number | AG01C4ED |
| Chemical Name | 4-Methyl-3-(propan-2-yl)-1H-pyrazol-5-amine |
| IUPAC Name | 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine |
| InChI | InChI=1S/C7H13N3/c1-4(2)6-5(3)7(8)10-9-6/h4H,1-3H3,(H3,8,9,10) |
| InChI Key | YRHGBIXKWWOYPC-UHFFFAOYSA-N |
| MDL Number | MFCD11209049 |
| Molecular Formula | C7H13N3 |
| Molecular Weight | 139.1982 |
| SMILES | CC(C1C(C)=C(N)NN=1)C |
| Synonyms | 4-methyl-3-(propan-2-yl)-1H-pyrazol-5-amine,
159976-73-5,
SCHEMBL5252528,
ZINC34496254,
AKOS009353320,
AKOS022474635,
|
| Complexity | 113 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.202g/mol |
| Monoisotopic Mass | 139.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number